SCHEMBL6043320

SCHEMBL6043320

COCCCN1CCN(CCCC[O])CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SLC29A1 Q99808 2/20 0.36
PAOX Q6QHF9 1/20 0.36
DRD2 P14416 1/20 0.36
HSD11B1 P28845 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
USP2 O75604 1/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8880908 0.94 ALDH1A1 (0.38) ALDH1A1KDM4ESLC29A1PAOXDRD2
SCHEMBL6945807 0.89 ALDH1A1 (0.38) ALDH1A1KDM4ESLC29A1PAOXDRD2
SCHEMBL10924619 0.87 ALDH1A1 (0.39) ALDH1A1KDM4ESLC29A1DRD2HRH3
SCHEMBL11575418 0.87
SCHEMBL3451890 0.85 HSD11B1 (0.42) ALDH1A1KDM4ESLC29A1PAOXDRD2
SCHEMBL6042277 0.85 DRD2 (0.40) ALDH1A1KDM4ESLC29A1DRD2HSD11B1
SCHEMBL11574905 0.84
SCHEMBL10930283 0.82 HSD11B1 (0.42) ALDH1A1KDM4ESLC29A1HSD11B1HRH3
SCHEMBL10927336 0.82 HRH3 (0.46) ALDH1A1PAOXHRH3GNAI3GNAO1
SCHEMBL11570576 0.82 HRH3 (0.46) ALDH1A1PAOXHRH3GNAI3GNAO1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides ELAN PHARMACEUTICALS, INC. 2006-04-27 US disclosed
WO-2003103652-A1 METHODS OF TREATING ALZHEIMER’S DISEASE USING AROMATICALLY SUBSTITUTED ω-AMINO-ALKANOIC ACID AMIDES AND ALKANOIC ACID DIAMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
US-5641778-A EXHIBIT RENIN-INHIBITING PROPERTIES AND CAN BE USED AS ANTIHYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-06-24 US disclosed
EP-0716077-A1 Aromatically substituted omega amino alcanoic acid amides and alcanoic diamides and their use as renine inhibitors CIBA-GEIGY AG (CH) 1996-06-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides APP, BACE1, BACE2 ALDH1A1 1039/4885KDM4E 1951/4885SLC29A1 2415/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.